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Physicochemical properties (MW, LogP) of all entries.
| BIMP_ID | Name | Mol Weight | LogP | HBD | HBA | TPSA | Rotatable Bonds |
|---|---|---|---|---|---|---|---|
|
3,5-dihydroxy-2-(4-hydroxyphenyl)-7-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
|
432.40
|
0.6
|
6
|
10
|
170.05
|
3
|
|
|
daphnodorin D2
|
526.50
|
5.1
|
6
|
9
|
160.82
|
3
|
|
|
(3E,7Z)-4,8,12-Trimethyltrideca-1,3,7,11-tetraene
|
218.38
|
6.4
|
0
|
0
|
0
|
7
|
|
|
(3S,5R,9R,10S,13R,14R,17R)-17-[(2R,5S)-5-ethyl-6-methylhept-6-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
412.70
|
9
|
1
|
1
|
20.23
|
6
|
|
|
(E)-3-(2-hydroxy-3-methoxy-1-benzofuran-5-yl)prop-2-enoic acid
|
234.20
|
2.2
|
2
|
5
|
79.9
|
3
|
|
|
Quercetin 3-rutinoside 7-galactoside
|
772.70
|
-3.1
|
13
|
21
|
348.58
|
9
|
|
|
Kaempferol 7-galactoside 3-rutinoside
|
756.70
|
-2.7
|
12
|
20
|
328.35
|
9
|
|
|
Glucopyranoside, 1-cyano-4,5-dihydroxy-2-cyclopenten-1-YL, beta-D-
|
303.26
|
-2.7
|
6
|
9
|
163.63
|
3
|
|
|
9-(1,3-Benzodioxol-5-yl)-1-(2,6-dihydroxyphenyl)-1-nonanone
|
370.40
|
6.2
|
2
|
5
|
75.99
|
10
|
|
|
2-(3,4-Dihydroxyphenyl)-5-hydroxy-6,7-dimethoxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-4-one
|
492.40
|
1.2
|
6
|
12
|
188.51
|
5
|
|
|
3,5,7,3'-Tetramethoxy-4'-hydroxyflavone
|
358.30
|
2.9
|
1
|
7
|
87.36
|
5
|
|
|
7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,6-dihydroxychromen-4-one
|
626.50
|
-1.4
|
11
|
17
|
289.66
|
7
|
|
|
3,4,6,7-Tetramethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizin-14-ol
|
409.50
|
3.6
|
1
|
6
|
60.39
|
4
|
|
|
(13aR)-3,6,7-trimethoxy-9,11,12,13,13a,14-hexahydrophenanthro[9,10-f]indolizin-4-ol
|
379.40
|
4.4
|
1
|
5
|
51.16
|
3
|
|
|
(13aS)-3,6,7-trimethoxy-13a-methyl-11,12,13,14-tetrahydro-9H-phenanthro[9,10-f]indolizin-4-ol
|
393.50
|
4.6
|
1
|
5
|
51.16
|
3
|
|
|
5-[(8aS)-6-(3,4-dimethoxyphenyl)-8a-methyl-2,3,5,8-tetrahydro-1H-indolizin-7-yl]-2-methoxyphenol
|
395.50
|
3.6
|
1
|
5
|
51.16
|
5
|
|
|
Glochidone
|
422.70
|
9.7
|
0
|
1
|
17.07
|
1
|
|
|
1-[(1R,9R,12R,19R)-12-ethyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6-trien-8-yl]ethanone
|
324.50
|
3.4
|
0
|
2
|
23.55
|
1
|
|
|
CID 13943202
|
398.80
|
0.6
|
2
|
7
|
105.59
|
4
|
|
|
Desacylcynaropicrin
|
262.30
|
0.3
|
2
|
4
|
66.76
|
0
|
|
|
(E,6R)-6-[(1'S,3R,6S,7S,7aS)-7-(2-carboxyethyl)-1',7-dimethyl-3'-methylidene-6-prop-1-en-2-ylspiro[2,5,6,7a-tetrahydro-1H-indene-3,2'-cyclopentane]-1'-yl]-2-methyl-4-oxohept-2-enoic acid
|
482.60
|
5.9
|
2
|
5
|
91.67
|
9
|
|
|
(E,6R)-6-[(3R,5R,9S,10R,13S,17S)-3-hydroxy-4,4,10,13,17-pentamethyl-2,3,5,6,9,11,12,16-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxohept-2-enoic acid
|
468.70
|
5.8
|
2
|
4
|
74.6
|
5
|
|
|
Cyclogalegenin
|
490.70
|
4.4
|
4
|
5
|
90.15
|
2
|
|
|
(1S,3R,6S,8R,9S,11S,12S,14S,15R,16R)-15-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,9,14-triol
|
492.70
|
4.6
|
5
|
5
|
101.15
|
5
|
|
|
11,13-Dihydroivalin
|
250.33
|
2.2
|
1
|
3
|
46.53
|
0
|
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